Ethyl m-fluorophenylcarbamate
TL;DR: Ethyl m-fluorophenylcarbamate (CAS 53355-60-5) is a chemical compound with molecular formula C9H10FNO2 and molecular weight 183.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-(3-fluorophenyl)carbamate
Also Known As: m-fluorophenyl carbamate, ethyl(3-fluorophenyl)carbamate, ethyl m-fluorophenylcarbamate, ethyl N-(3-fluorophenyl)carbamate, Carbamic acid, (3-fluorophenyl)-, ethyl ester (9CI)
| Molecular Formula | C9H10FNO2 |
|---|---|
| Molecular Weight | 183.07 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 183.06955 |
| Heavy Atoms | 13 |
| Complexity | 175.0 |
Chemical Identifiers
| CAS Number | 53355-60-5 |
|---|---|
| SMILES | CCOC(=O)NC1=CC(=CC=C1)F |
| InChIKey | RDCNKBVMLNCTEV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl m-fluorophenylcarbamate (CAS 53355-60-5), with molecular formula C9H10FNO2 and molecular weight 183.07 g/mol. IUPAC: ethyl N-(3-fluorophenyl)carbamate.
Chemical Property Profile of Ethyl m-fluorophenylcarbamate
Property Insights of Ethyl m-fluorophenylcarbamate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl m-fluorophenylcarbamate. With a topological polar surface area (TPSA) of 38.3 Ų, Ethyl m-fluorophenylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl m-fluorophenylcarbamate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl m-fluorophenylcarbamate?
The CAS number of Ethyl m-fluorophenylcarbamate is 53355-60-5.
What is the molecular formula of Ethyl m-fluorophenylcarbamate?
The molecular formula of Ethyl m-fluorophenylcarbamate is C9H10FNO2.
What is the molecular weight of Ethyl m-fluorophenylcarbamate?
The molecular weight of Ethyl m-fluorophenylcarbamate is 183.07 g/mol.
Where can I buy Ethyl m-fluorophenylcarbamate?
You can request a quote for Ethyl m-fluorophenylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl m-fluorophenylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl m-fluorophenylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.